Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13754138 | 0.85 | NR1H4 (0.52) | MEN1KMT2AALDH1A1KDM4ELMNA | |
| SCHEMBL13754134 | 0.82 | PIN1 (0.40) | MEN1KMT2AALDH1A1KDM4ELMNA | |
| SCHEMBL13754136 | 0.81 | ESRRG (0.45) | MEN1KMT2AALDH1A1LMNAACACB | |
| SCHEMBL4451298 | 0.80 | ADRB2 (0.42) | MEN1KMT2AALDH1A1LMNAMAPK1 | |
| SCHEMBL13754143 | 0.80 | NR1H4 (0.51) | ACACBRAB9ATP53TSHRNR1H4 | |
| SCHEMBL13754142 | 0.78 | ACACB (0.45) | MEN1KMT2AALDH1A1LMNAACACB | |
| SCHEMBL4445520 | 0.78 | MEN1 (0.41) | MEN1KMT2AALDH1A1LMNAACACB | |
| SCHEMBL13754141 | 0.77 | NR4A2 (0.44) | MEN1KMT2ALMNAACACBNPC1 | |
| SCHEMBL13754169 | 0.77 | NR1H4 (0.45) | LMNAMAPTSMN1; SMN2NR1H4 | |
| SCHEMBL13754176 | 0.76 | ESRRG (0.44) | MEN1KMT2AALDH1A1LMNAPPARG |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7572938-B2 | Precursors for ketones and aldehydes | GIVAUDAN SA (CH) | 2009-08-11 | — | — | US | disclosed |
| US-7572938-B2 | Precursors for ketones and aldehydes | GIVAUDAN SA (CH) | 2009-08-11 | — | — | US | disclosed |